heteronuclear single quantum coherence total...
URL: https://www.chemotion-repository.net/inchikey/WHSOXNXKLMPMCN-UHFFFAOYSA-N/CHMO0001071
Dataset description:
dataset for heteronuclear single quantum coherence total correlation spectroscopy (HSQC-TOCSY)\n\n
Source: heteronuclear single quantum coherence total correlation spectroscopy (HSQC-TOCSY)
Chemical Info
| InChI | InChI=1S/C60H42N2S2/c1-5-13-53-47(9-1)48-10-2-6-14-54(48)61(53)45-29-25-43(26-30-45)57-33-35-59(63-57)51-37-39-17-21-41(51)23-19-40-18-22-42(24-20-39)52(38-40)60-36-34-58(64-60)44-27-31-46(32-28-44)62-55-15-7-3-11-49(55)50-12-4-8-16-56(50)62/h1-18,21-22,25-38H,19-20,23-24H2 |
|---|---|
| SMILES | c1ccc2c(c1)n(c1ccc(cc1)c1ccc(s1)c1cc3CCc4ccc(CCc1cc3)cc4c1ccc(s1)c1ccc(cc1)n1c3ccccc3c3c1cccc3)c1c2cccc1 |
| InChI Key | WHSOXNXKLMPMCN-UHFFFAOYSA-N |
| Molecular Formula | C60H42N2S2 |
| Exact Mass | 855.119 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | b07edaf3-7f6b-487b-870b-35c00282b961 |
| Package id | 10-14272-whsoxnxklmpmcn-uhfffaoysa-n-chmo0001071 |
| Resource type | HTML |
| State | active |